(Z)-2-[2-[(2,6-dimethylphenyl)methylsulfanyl]phenyl]-3-methoxy-prop-2-enoic acid

Systemtic Name: (Z)-2-[2-[(2,6-dimethylphenyl)methylsulfanyl]phenyl]-3-methoxy-prop-2-enoic acid Openeye Name: (Z)-2-[2-[(2,6-dimethylphenyl)methylsulfanyl]phenyl]-3-methoxy-prop-2-enoic acid CAS Name: (Z)-2-[2-[(2,6-dimethylphenyl)methylthio]phenyl]-3-methoxy-2-propenoic acid IUPAC Name: (Z)-2-[2-[(2,6-dimethylphenyl)methylsulfanyl]phenyl]-3-methoxyprop-2-enoic acid Traditional Name: (Z)-2-[2-[(2,6-dimethylbenzyl)thio]phenyl]-3-methoxy-acrylic acid Formula: C19H20O3S MolecularWeight: 328.4253

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)CSC2=CC=CC=C2C(=COC)C(=O)O

Isomeric SMILES

CC1=C(C(=CC=C1)C)CSC2=CC=CC=C2/C(=C/OC)/C(=O)O

InChI

InChI=1S/C19H20O3S/c1-13-7-6-8-14(2)17(13)12-23-18-10-5-4-9-15(18)16(11-22-3)19(20)21/h4-11H,12H2,1-3H3,(H,20,21)/b16-11-